BDBM50170634 1-((1R,2S)-1-{2-[2-(4-Chloro-phenyl)-benzooxazol-4-yl]-ethyl}-2-hydroxy-propyl)-1H-imidazole-4-carboxylic acid amide::CHEMBL436332

SMILES: C[C@H](O)[C@@H](CCc1cccc2oc(nc12)-c1ccc(Cl)cc1)n1cnc(c1)C(N)=O

InChI Key: InChIKey=HARPZZZNCPVLRK-SCLBCKFNSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50170634   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine deaminase (Homo sapiens (Human))	BDBM50170634 (1-((1R,2S)-1-{2-[2-(4-Chloro-phenyl)-benzooxazol-4...) Show SMILES C[C@H](O)[C@@H](CCc1cccc2oc(nc12)-c1ccc(Cl)cc1)n1cnc(c1)C(N)=O Show InChI InChI=1S/C22H21ClN4O3/c1-13(28)18(27-11-17(21(24)29)25-12-27)10-7-14-3-2-4-19-20(14)26-22(30-19)15-5-8-16(23)9-6-15/h2-6,8-9,11-13,18,28H,7,10H2,1H3,(H2,24,29)/t13-,18+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory concentration against adenosine deaminase				J Med Chem 48: 4750-3 (2005) Article DOI: 10.1021/jm050413g BindingDB Entry DOI: 10.7270/Q2JD4WBG
					More data for this Ligand-Target Pair